(Q37001479)

17 August 2017

Interactions between phosphate and water in solution: a natural bond orbital based analysis in a QM/MM framework (English)

1 reference

17 August 2017

Yang Yang

1

1 reference

17 August 2017

Qiang Cui

series ordinal

2

1 reference

17 August 2017

language of work or name

English

0 references

publication date

29 March 2007

1 reference

Journal of Physical Chemistry B

17 August 2017

1 reference

17 August 2017

111

1 reference

17 August 2017

16

1 reference

17 August 2017

3999-4002

1 reference

Unified Approach for Molecular Dynamics and Density-Functional Theory

17 August 2017

1 reference

PubMed Central

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=2596991

Theoretical studies of enzymic reactions: dielectric, electrostatic and steric stabilization of the carbonium ion in the reaction of lysozyme

29 September 2017

1 reference

PubMed Central

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=2596991

Polarization and charge-transfer effects in aqueous solution via ab initio QM/MM simulations

29 September 2017

1 reference

PubMed Central

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=2596991

Solute-solvent charge transfer in aqueous solution

4 September 2018

1 reference

PubMed

https://pubmed.ncbi.nlm.nih.gov/17391023

inferred from PubMed ID database lookup

12 December 2020

based on heuristic

Identifiers

DOI

10.1021/JP070706G

1 reference

17 August 2017

1 reference

17 August 2017

PubMed publication ID

17391023

1 reference